Basic information
- CAS
58886-94-5- Standard SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCCC- InChIKey
NHKDEMRRYWOJOF-UHFFFAOYSA-N- Molecular formula
- C44H88O2
- Average molar mass
- 649.2 g/mol
- Monoisotopic mass
- 648.67843205
Overview
Octadecanoic acid, hexacosyl ester has been reported in Platanus orientalis with data available.
Names & identifiers
- Preferred name
- Octadecanoic acid, hexacosyl ester
- IUPAC
- hexacosyl octadecanoate
- English name
- Octadecanoic acid, hexacosyl ester
- Molecular formula
- C44H88O2
- Molecular weight
- 649.17
Names & synonyms
hexacosyl octadecanoateOctadecanoic acid, hexacosyl ester58886-94-5hexacosyl stearatehexacosanyl octadecanoateZS26KDM4DZn-Hexacosyl n-octadecanoateSCHEMBL1043773DTXSID60207593LMFA07011652WE 26:0/18:0
Database identifiers
- CAS
58886-94-5- PubChem CID
- 3085149
- DTXSID
DTXSID60207593- UNII
- ZS26KDM4DZ
Properties
Computed structural properties
- XLogP
- 21.7
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 42
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 544
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]
Chemistry & industry
Suppliers1 total
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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